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Home > Boronic Acids > 850864-58-3
850864-58-3 | (2-(Benzyloxy)-5-chloropyridin-3-yl)boronic acid
CAS No: 850864-58-3 Catalog No: AG004OOD MDL No:MFCD16660269
Product Description
Catalog Number:
AG004OOD
Chemical Name:
(2-(Benzyloxy)-5-chloropyridin-3-yl)boronic acid
CAS Number:
850864-58-3
Molecular Formula:
C12H11BClNO3
Molecular Weight:
263.4846
MDL Number:
MFCD16660269
IUPAC Name:
(5-chloro-2-phenylmethoxypyridin-3-yl)boronic acid
InChI:
InChI=1S/C12H11BClNO3/c14-10-6-11(13(16)17)12(15-7-10)18-8-9-4-2-1-3-5-9/h1-7,16-17H,8H2
InChI Key:
WSTGGDQWIOLAIE-UHFFFAOYSA-N
SMILES:
Clc1cnc(c(c1)B(O)O)OCc1ccccc1
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.052g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
263.484g/mol
Monoisotopic Mass:
263.052g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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